CID 6510087

81892-52-6

Structural Information

Molecular Formula
C12H14ClN3O2
SMILES
CN(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Cl
InChI
InChI=1S/C12H14ClN3O2/c1-15(2)12(17)16-6-5-10(14-18)9-7-8(13)3-4-11(9)16/h3-4,7,18H,5-6H2,1-2H3/b14-10-
InChIKey
ZUCXFPUJJXJECB-UVTDQMKNSA-N
Compound name
(4Z)-6-chloro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

267.07745 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.08473 157.8
[M+Na]+ 290.06667 165.7
[M-H]- 266.07017 162.2
[M+NH4]+ 285.11127 175.3
[M+K]+ 306.04061 162.6
[M+H-H2O]+ 250.07471 151.2
[M+HCOO]- 312.07565 174.9
[M+CH3COO]- 326.09130 203.0
[M+Na-2H]- 288.05212 162.0
[M]+ 267.07690 159.0
[M]- 267.07800 159.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe